BCH1I3 -OEChem-04022106072D 33 35 0 0 0 0 0 0 0999 V2000 5.1184 3.7004 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7505 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.0875 2.8655 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7195 -0.6354 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.7505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.2495 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.0859 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7026 1.7441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9595 2.4132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6808 1.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5116 0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1674 3.3913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0084 2.1042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4242 4.0605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2653 2.7733 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4732 3.7514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.5595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7974 1.0211 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8795 1.4977 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.9405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5531 4.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6756 2.5817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.5605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0124 4.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -4.0605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 2 20 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 23 1 0 0 0 0 5 33 1 0 0 0 0 6 9 1 0 0 0 0 6 13 1 0 0 0 0 6 24 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 25 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 10 15 2 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 2 0 0 0 0 15 19 1 0 0 0 0 15 26 1 0 0 0 0 16 20 1 0 0 0 0 16 27 1 0 0 0 0 17 21 2 0 0 0 0 17 28 1 0 0 0 0 18 22 1 0 0 0 0 18 29 1 0 0 0 0 19 22 2 0 0 0 0 19 30 1 0 0 0 0 20 23 2 0 0 0 0 21 23 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 M END $$$$